ID: 50401
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1=C2C(=O)C(C)C1)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -16.165
InChIKey:GAQADYHINFUBRA-UHFFFAOYSA-N
ID: 50402
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 50403
SMILES:C1(=O)C(C)CC2c3c(cc(C)cc3O)OC(C)(C)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -16.74
InChIKey:FBTNCCCNQCOTSM-UHFFFAOYSA-N
ID: 50404
SMILES:C1(O)C(C)(C)Oc2c(c(O)cc(CCCCC)c2)C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 280.364
CB1 binding score: -18.858
InChIKey:FCEJYUOQVZGCIK-UHFFFAOYSA-N
ID: 50405
SMILES:C12C(C(C)(C)Oc3c1c(O)cc(CCCCCC)c3)CC1=C(C(OC)CC3C1(C)CCC(=O)C3(C)C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 508.743
CB1 binding score: -11.401
InChIKey:CSJRLUQFZANEGC-UHFFFAOYSA-N
ID: 50406
SMILES:Oc1c2c(cc(C)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 50407
SMILES:O1C(CC(C)C)c2c(O)cc(CCCCC)cc2c2cc(O)c(C)cc12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -13.583
InChIKey:SXKLIDSNXAKTNU-UHFFFAOYSA-N
ID: 50408
SMILES:O=C(c1ccc2c(c1)OC(C)(C)C1CCC(CO)=CC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -15.918
InChIKey:KMMSOZGLYNIGSO-UHFFFAOYSA-N
ID: 50409
SMILES:C1C2(OC)c3c(O)cc(C)cc3OC(C)(C)C1C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.322
CB1 binding score: -13.761
InChIKey:ZWKHOXGMIDNMJS-UHFFFAOYSA-N
ID: 50410
SMILES:c1(CCCCC)cc2c(c(O)c1C(O)=O)C1C(C(C)(C)O2)CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.507
InChIKey:YKKHSYLGQXKVMO-UHFFFAOYSA-N
ID: 50411
SMILES:C(c1cc(OC)c2c(c1C)OC(C)(C)C(OC(C=C(C)C)=O)C2=O)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -14.028
InChIKey:NYKNHQMIXSFHRF-UHFFFAOYSA-N
ID: 50412
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C(=O)O)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.707
InChIKey:OGXXAQFMAFTSRU-UHFFFAOYSA-N
ID: 50413
SMILES:C(CC)CCc1ccc2c(c1OC)C=CC(CCC=C(C)C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -14.96
InChIKey:MKFIPCTVUWMRBV-UHFFFAOYSA-N
ID: 50414
SMILES:Oc1cc(CCC)cc2c1C1C(C(C)(C)O2)CCC(O)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -19.509
InChIKey:XAJXLANJASZEBB-UHFFFAOYSA-N
ID: 50415
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C(=O)OC)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.943
InChIKey:CCMWHLPOQSRJEP-UHFFFAOYSA-N
ID: 50416
SMILES:c1(CCCC)cc(O)c(C2C=C(CCC=C(C)C)C(=O)O2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -16.642
InChIKey:SPASQAHJKSUWKO-UHFFFAOYSA-N
ID: 50417
SMILES:CC(C)=CCCC(=CCc1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 50418
SMILES:c1c(Cc2ccccc2O)cc(O)c2c1OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.458
CB1 binding score: -14.683
InChIKey:PZZSTIKPEAKEPC-UHFFFAOYSA-N
ID: 50419
SMILES:C1CC2C(C)(C(Cc3c(OC)cc(CCCCC)cc3O)(C)C1C)CCCC2=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.631
CB1 binding score: -14.536
InChIKey:JEBRVWQRBWTSPK-UHFFFAOYSA-N
ID: 50420
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)CC2C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -17.334
InChIKey:LKJNAKRLOPZHAJ-UHFFFAOYSA-N
ID: 50421
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1C2=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.524
InChIKey:USODFRMMCODFKQ-UHFFFAOYSA-N